CS-0311290
tert-Butyl 3-((tert-butoxycarbonyl)amino)-3-formylazepane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2600792-68-3
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₃₀N₂O₅
Molecular Weight
342.43
Synonyms
1H-Azepine-1-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-formylhexahydro-, 1,1-dimethylethyl ester
SMILES
O=C(N1CC(C=O)(NC(OC(C)(C)C)=O)CCCC1)OC(C)(C)C
Tpsa
84.94
Logp
2.8698
H Acceptors
5
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₃₀N₂O₅
Molecular Weight: 342.43
Synonyms: 1H-Azepine-1-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-formylhexahydro-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC(C=O)(NC(OC(C)(C)C)=O)CCCC1)OC(C)(C)C
Tpsa: 84.94
Logp: 2.8698
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₃₀N₂O₅
Molecular Weight:
342.43
Synonyms:
1H-Azepine-1-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-3-formylhexahydro-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC(C=O)(NC(OC(C)(C)C)=O)CCCC1)OC(C)(C)C
Tpsa:
84.94
Logp:
2.8698
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₉O₈P
Molecular Weight: 382.30
Synonyms: 4H-Pyran-2-carboxylic acid, 6-[(dimethoxyphosphinyl)methyl]-4-oxo-3-(phenylmethoxy)-, methyl ester
SMILES: O=C(C1=C(OCC2=CC=CC=C2)C(C=C(CP(OC)(OC)=O)O1)=O)OC
Tpsa: 101.27
Logp: 2.9913
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₉O₈P
Molecular Weight:
382.30
Synonyms:
4H-Pyran-2-carboxylic acid, 6-[(dimethoxyphosphinyl)methyl]-4-oxo-3-(phenylmethoxy)-, methyl ester
SMILES:
O=C(C1=C(OCC2=CC=CC=C2)C(C=C(CP(OC)(OC)=O)O1)=O)OC
Tpsa:
101.27
Logp:
2.9913
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁FO₃
Molecular Weight: 210.20
Synonyms: None
SMILES: O=C(C1(C)OC2=CC(F)=CC=C2C1)OC
Tpsa: 35.53
Logp: 1.6923
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁FO₃
Molecular Weight:
210.20
Synonyms:
None
SMILES:
O=C(C1(C)OC2=CC(F)=CC=C2C1)OC
Tpsa:
35.53
Logp:
1.6923
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: MFCD20661020
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇BO₄
Molecular Weight: 177.95
Synonyms: None
SMILES: O=C(C1=C(B(O)OC2)C2=CC=C1)O
Tpsa: 66.76
Logp: -0.3975
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
MFCD20661020
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BO₄
Molecular Weight:
177.95
Synonyms:
None
SMILES:
O=C(C1=C(B(O)OC2)C2=CC=C1)O
Tpsa:
66.76
Logp:
-0.3975
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1